Journal of Physical Chemistry B

Journal of Physical Chemistry B, Vol.116, No.22 Entire volume, number list

ISSN: 1520-6106 (Print)

In this Issue (38 articles)

6233 - 6249	Direct Simulation of Magnetic Resonance Relaxation Rates and Line Shapes from Molecular Trajectories Rangel DP, Baveye PC, Robinson BH
6250 - 6260	Speciation of Copper-Peptide Complexes in Water Solution Using DFTB and DFT Approaches: Case of the [Cu(HGGG)(Py)] Complex Bruschi M, Bertini L, Bonacic-Koutecky V, De Gioia L, Mitric R, Zampella G, Fantucci P
6261 - 6268	Charge Transfer Effects in the GroEL-GroES Chaperonin Tetramer in Solution Anisimov VM, Bliznyuk AA
6269 - 6278	Energetics of Mutation-Induced Changes in Potency of Lersivirine against HIV-1 Reverse Transcriptase Kar P, Knecht V
6279 - 6287	Water Model Tuning for Improved Reproduction of Rotational Diffusion and NMR Spectral Density Takemura K, Kitao A
6288 - 6301	Initiation of the Reaction of Deamidation in Triosephosphate Isomerase: Investigations by Means of Molecular Dynamics Simulations Ugur I, Aviyente V, Monard G
6302 - 6310	Importance of Length and Sequence Order on Magnesium Binding to Surface-Bound Oligonucleotides Studied by Second Harmonic Generation and Atomic Force Microscopy Holland JG, Geiger FM
6311 - 6325	Dynamics of Metastable beta-Hairpin Structures in the Folding Nucleus of Amyloid beta-Protein Cruz L, Rao JS, Teplow DB, Urbanc B
6326 - 6335	Hydrophobic Moments, Shape, and Packing in Disordered Proteins Rawat N, Biswas P
6336 - 6345	Proton Transport in a Membrane Protein Channel: Two-Dimensional Infrared Spectrum Modeling Liang CW, Knoester J, Jansen TLC
6346 - 6355	Direct Observation of Ligand Rebinding Pathways in Hemoglobin Using Femtosecond Mid-IR Spectroscopy Kim S, Park J, Lee T, Lim M
6356 - 6360	Calorimetric Determination of Rate Constants and Enthalpy Changes for Zero-Order Reactions Sousa LAE, Beezer AE, Hansen LD, Clapham D, Connor JA, Gaisford S
6361 - 6368	Adenosine-Triggered Elimination of Methylene Blue Noncovalently Bound to Immobilized Functional dsDNA-Aptamer Constructs Dai Y, Chakraborty B, Ge BX, Yu HZ
6369 - 6379	Reactions of Deprotonated Tyrosine and Tryptophan with Electronically Excited Singlet Molecular Oxygen (a(1)Delta(g)): A Guided-Ion-Beam Scattering, Statistical Modeling, and Trajectory Study Liu FW, Fang YG, Chen Y, Liu JB
6380 - 6386	Dependence of Pyranose Ring Puckering on Anomeric Configuration: Methyl Idopyranosides Sattelle BM, Bose-Basu B, Tessier M, Woods RJ, Serianni AS, Almond A
6387 - 6396	Nitroxide Sensing of a DNA Microenvironment: Mechanistic Insights from EPR Spectroscopy and Molecular Dynamics Simulations Popova AM, Hatmal MM, Frushicheva MP, Price EA, Qin PZ, Haworth IS
6397 - 6403	Carbon-Deuterium Bonds as Probes of Protein Thermal Unfolding Yu WN, Dawson PE, Zimmermann J, Romesberg FE
6404 - 6410	Redox Properties and Thiol Reactivity of Geldanamycin and its Analogues in Aqueous Solutions Samuni A, Goldstein S
6411 - 6415	Behavior of 4-Hydroxynonenal in Phospholipid Membranes Vazdar M, Jurkiewicz P, Hof M, Jungwirth P, Cwiklik L
6416 - 6424	Ion Pair Reinforced Semi-Interpenetrating Polymer Network for Direct Methanol Fuel Cell Applications Fang CL, Julius D, Tay SW, Hong L, Lee JY
6425 - 6430	Aggregate Transitions in Aqueous Solutions of Sodium Dodecylsulfate with a "Gemini-Type" Organic Salt Yu DF, Tian MZ, Fan YX, Ji G, Wang YL
6431 - 6438	Influences of Mutations on the Electrostatic Binding Free Energies of Chloride Ions in Escherichia coli CIC Yu T, Wang XQ, Sang JP, Pan CX, Zou XW, Chen TY, Zou XQ
6439 - 6442	Elastic Properties of Nanoparticle Monolayer Foams Langer U, Ray A, Aliaskarisohi S, Fischer TM
6443 - 6454	Are Ellipsoids Feasible Micelle Shapes? An Answer Based on a Molecular-Thermodynamic Model of Nonionic Surfactant Micelles Iyer J, Blankschtein D
6455 - 6460	Interfacial Water Facilitates Energy Transfer by Inducing Extended Vibrations in Membrane Lipids Mashaghi A, Partovi-Azar P, Jadidi T, Nafari N, Esfarjani K, Maass P, Tabar MRR, Bakker HJ, Bonn M
6461 - 6464	Ionic Structures of Nanobased FeCl3/[C(4)min]Cl Ionic Liquids Li JG, Hu YF, Sun SF, Ling S, Zhang JZ
6465 - 6475	Unravelling the Hydration Structure of ThX4 (X = Br, Cl) Water Solutions by Molecular Dynamics Simulations and X-ray Absorption Spectroscopy Spezia R, Beuchat C, Vuilleumier R, D'Angelo P, Gagliardi L
6476 - 6487	Free-Energy and Structural Analysis of Ion Solvation and Contact Ion-Pair Formation of Li+ with BF4- and PF6- in Water and Carbonate Solvents Takeuchi M, Matubayasi N, Kameda Y, Minofar B, Ishiguro S, Umebayashi Y
6488 - 6498	Size Dependence of Molecular Self-Assembling in Stacked Aggregates. 1. NMR Investigation of Ciprofloxacin Self-Association Turcu I, Bogdan M
6499 - 6505	Low-Energy Vibrational Dynamics of Cesium Borate Glasses Crupi C, D'Angelo G, Vasi C
6506 - 6513	Quasi-Chemical Theory of Cosolvent Hydrophobic Preferential Interactions Priya MH, Merchant S, Asthagiri D, Paulaitis ME
6514 - 6521	Structures and Surface Tensions of Fluids near Solid Surfaces: An Integral Equation Theory Study Xu MJ, Zhang C, Du ZJ, Mi JG
6522 - 6528	Oxidation of 3,6-Dioxa-1,8-octanedithiol by Platinum(IV) Anticancer Prodrug and Model Complex: Kinetic and Mechanistic Studies Huo SY, Shen SG, Liu DZ, Shi TS
6529 - 6535	Molecular Simulation of the Thermophysical Properties of N-Functionalized Alkylimidazoles Turner CH, Cooper A, Zhang ZT, Shannon MS, Bara JE
6536 - 6542	Overcoming the "Coffee-Stain" Effect by Compositional Marangoni-Flow-Assisted Drop-Drying Majumder M, Rendall CS, Eukel JA, Wang JYL, Behabtu N, Pint CL, Liu TY, Orbaek AW, Mirri F, Nam J, Barron AR, Hauge RH, Schmid HK, Pasquali M
6543 - 6552	Absorption Spectra of Model Single Chains of Conducting Polyaniline Petrova J, Romanova J, Madjarova G, Ivanova A, Tadjer A
6553 - 6560	Conductivity and Spectroscopic Investigation of Bis(trifluoromethanesulfonyl)imide Solution in Ionic Liquid 1-Butyl-3-methylimidazolium Bis(trifluoromethanesulfonyl)imide Yu L, Pizio BS, Vaden TD
6561 - 6568	Visualization of Two-Dimensional Single Chain Conformations Solubilized in a Miscible Polymer Blend Monolayer by Atomic Force Microscopy Sugihara K, Kumaki J